DSSP OUTPUT
==== Secondary Structure Definition by the program DSSP, CMBI version 3.0.1 ==== DATE=2019-06-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
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COMPND .
SOURCE .
AUTHOR .
504 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
20586.9 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
276 54.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
24 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
28 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES .
2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES .
1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES .
41 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
30 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
99 19.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
9 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES .
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** .
0 0 0 1 1 2 0 1 0 3 2 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX .
4 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER .
4 1 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER .
0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET .
# RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA CHAIN AUTHCHAIN
1 1 A 0 0 51 0, 0.0 2,-0.4 0, 0.0 166,-0.1 0.000 360.0 360.0 360.0 141.5 17.8 -1.5 -9.0
2 2 S - 0 0 42 1,-0.2 4,-0.4 2,-0.0 3,-0.2 -0.610 360.0-151.8 -75.8 132.1 18.6 -0.1 -5.6
3 3 D S > S+ 0 0 133 -2,-0.4 3,-1.6 1,-0.2 -1,-0.2 0.866 94.1 60.1 -68.9 -37.9 22.1 1.3 -5.5
4 4 T T 3 S+ 0 0 87 1,-0.3 -1,-0.2 17,-0.1 -2,-0.0 0.824 94.9 66.6 -61.5 -31.3 22.5 0.8 -1.8
5 5 H T 3 S+ 0 0 18 -3,-0.2 -1,-0.3 16,-0.1 -2,-0.2 0.755 73.7 119.4 -60.7 -31.0 21.9 -2.9 -2.5
6 6 T < - 0 0 67 -3,-1.6 2,-0.3 -4,-0.4 15,-0.2 0.054 52.5-146.3 -46.5 148.6 25.2 -3.3 -4.4
7 7 F - 0 0 26 13,-1.6 2,-0.3 326,-0.0 13,-0.3 -0.908 17.5-162.2-128.3 147.6 27.7 -5.7 -2.9
8 8 L - 0 0 103 -2,-0.3 2,-0.5 324,-0.2 7,-0.0 -0.866 31.7-119.8-117.8 153.1 31.5 -6.1 -2.6
9 9 L > - 0 0 21 -2,-0.3 3,-0.7 1,-0.1 320,-0.1 -0.875 7.9-149.7-118.1 135.0 32.9 -9.5 -1.8
10 10 E T 3 S+ 0 0 58 -2,-0.5 2,-0.2 1,-0.3 -1,-0.1 0.712 93.1 31.1 -66.4 -33.8 35.0 -10.6 1.1
11 11 W T 3 S+ 0 0 56 98,-0.1 99,-1.9 3,-0.0 2,-0.4 -0.417 84.0 111.2-135.4 82.6 36.9 -13.3 -0.6
12 12 F < - 0 0 43 -3,-0.7 99,-0.1 -2,-0.2 3,-0.1 -0.996 48.5-154.4-137.6 130.2 37.5 -12.6 -4.2
13 13 K S S+ 0 0 186 -2,-0.4 2,-0.3 97,-0.3 -1,-0.1 0.955 87.3 25.6 -67.3 -45.4 40.8 -11.9 -5.6
14 14 M S S- 0 0 117 -3,-0.1 -1,-0.2 1,-0.1 -3,-0.0 -0.856 91.9-100.8-123.4 155.4 39.2 -10.0 -8.4
15 15 F - 0 0 161 -2,-0.3 2,-0.1 1,-0.1 -1,-0.1 -0.279 42.5-103.7 -70.4 150.6 35.9 -8.2 -8.8
16 16 P - 0 0 40 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.460 14.6-136.2 -74.0 150.1 33.0 -9.8 -10.6
17 17 E S S+ 0 0 176 -2,-0.1 2,-0.2 2,-0.1 -2,-0.1 0.820 89.0 59.1 -70.4 -34.8 32.1 -8.8 -14.1
18 18 F S S- 0 0 25 26,-0.1 2,-0.2 1,-0.1 28,-0.1 -0.631 86.9-116.9-102.4 153.7 28.5 -8.7 -13.2
19 19 Q - 0 0 76 -2,-0.2 25,-2.1 26,-0.2 2,-0.3 -0.591 28.7-174.8 -88.4 152.2 26.7 -6.7 -10.6
20 20 S E -A 43 0A 11 -13,-0.3 -13,-1.6 -2,-0.2 23,-0.2 -0.992 6.8-157.7-142.4 145.8 25.0 -8.3 -7.6
21 21 N E -A 42 0A 10 21,-1.3 21,-2.3 -2,-0.3 2,-0.4 -0.987 3.1-164.6-130.8 129.2 22.9 -6.8 -4.9
22 22 P E +A 41 0A 0 0, 0.0 2,-0.3 0, 0.0 19,-0.2 -0.953 36.3 110.2-103.8 140.2 22.0 -8.0 -1.4
23 23 F E -A 40 0A 72 17,-1.8 17,-2.4 -2,-0.4 2,-0.3 -0.893 59.2 -62.9-175.4-159.6 19.2 -6.4 0.6
24 24 F E -A 39 0A 22 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.865 29.4-154.6-118.3 150.1 15.7 -7.0 2.0
25 25 I E -A 38 0A 9 13,-2.2 13,-2.4 -2,-0.3 134,-0.1 -0.922 30.4-107.5-121.2 138.2 12.4 -7.7 0.3
26 26 S E +A 37 0A 15 -2,-0.4 2,-0.3 133,-0.2 136,-0.3 -0.309 44.4 175.7 -66.6 154.6 9.1 -6.8 1.9
27 27 G - 0 0 0 9,-1.3 128,-0.2 6,-1.2 3,-0.1 -0.903 34.5-140.5-150.1 170.0 7.0 -9.7 3.2
28 28 E + 0 0 92 -2,-0.3 5,-0.1 121,-0.2 127,-0.1 -0.457 44.8 140.4-134.2 63.2 3.9 -10.5 5.0
29 29 S S S+ 0 0 20 3,-0.3 2,-0.3 124,-0.2 -1,-0.1 0.953 89.8 12.5 -65.6 -44.8 4.8 -13.4 7.2
30 30 Y S S- 0 0 132 2,-0.3 2,-0.5 -3,-0.1 -1,-0.1 -0.765 120.2 -70.0-121.0 161.5 2.7 -11.8 9.8
31 31 A S S+ 0 0 75 -2,-0.3 2,-0.1 -3,-0.1 -3,-0.1 -0.438 99.6 95.2 -60.4 114.4 0.4 -8.9 9.0
32 32 G - 0 0 23 -2,-0.5 -2,-0.3 -5,-0.1 -5,-0.3 -0.412 54.8-159.0 162.8 117.1 2.9 -6.3 8.3
33 33 I S S+ 0 0 100 2,-0.1 -6,-1.2 -2,-0.1 -4,-0.1 0.956 105.1 37.0 -69.3 -47.3 4.6 -5.1 5.1
34 34 Y S S+ 0 0 175 1,-0.2 104,-0.2 -8,-0.1 -1,-0.1 0.901 109.4 64.6 -69.4 -43.2 7.4 -3.7 7.1
35 35 V S S+ 0 0 29 102,-0.1 103,-2.0 103,-0.1 2,-0.4 0.907 94.0 55.5 -61.6 -52.1 7.6 -6.4 9.7
36 36 P E + B 0 137A 0 0, 0.0 -9,-1.3 0, 0.0 2,-0.4 -0.674 66.7 175.0 -80.9 136.3 8.6 -9.4 7.7
37 37 T E -AB 26 136A 15 99,-3.1 99,-1.8 -2,-0.4 2,-0.5 -0.980 13.2-159.8-139.1 125.8 11.8 -8.8 5.7
38 38 L E -A 25 0A 0 -13,-2.4 -13,-2.2 -2,-0.4 2,-0.1 -0.877 18.1-127.6-110.0 137.3 13.5 -11.4 3.7
39 39 A E -A 24 0A 0 -2,-0.5 88,-2.8 93,-0.3 2,-0.3 -0.486 30.0-171.5 -74.4 145.9 17.1 -11.2 2.7
40 40 A E -AC 23 126A 10 -17,-2.4 -17,-1.8 37,-0.2 2,-0.4 -0.995 16.9-157.2-140.9 147.6 17.8 -11.7 -0.9
41 41 E E -AC 22 125A 0 84,-2.5 84,-2.8 -2,-0.3 2,-0.5 -0.992 12.8-166.0-124.7 121.9 20.9 -12.0 -3.0
42 42 V E -AC 21 124A 18 -21,-2.3 -21,-1.3 -2,-0.4 2,-0.6 -0.921 5.2-172.3-112.5 125.2 20.7 -11.1 -6.7
43 43 V E -AC 20 123A 2 80,-2.0 80,-1.5 -2,-0.5 -23,-0.2 -0.956 21.7-134.8-117.9 119.7 23.4 -12.2 -9.1
44 44 K - 0 0 36 -25,-2.1 78,-0.1 -2,-0.6 77,-0.1 -0.292 33.3 -92.5 -69.8 151.6 23.0 -10.7 -12.6
45 45 G > - 0 0 3 1,-0.2 4,-0.6 75,-0.1 74,-0.2 -0.377 29.6-131.4 -62.9 140.8 23.5 -13.0 -15.5
46 46 N T 4 S+ 0 0 65 72,-2.6 2,-0.6 75,-0.2 3,-0.2 0.900 94.5 46.2 -63.0 -39.0 27.0 -12.9 -16.7
47 47 K T 4 S- 0 0 140 72,-1.4 -1,-0.2 71,-0.3 6,-0.2 -0.917 133.9 -24.6-116.1 128.9 25.9 -12.4 -20.2
48 48 N T 4>S+ 0 0 97 -2,-0.6 5,-2.6 4,-0.1 4,-0.4 0.926 75.7 169.1 47.1 58.1 23.2 -9.9 -21.2
49 49 A T <5 + 0 0 10 -4,-0.6 73,-0.1 -3,-0.2 -3,-0.1 0.959 66.2 46.2 -66.6 -49.2 21.7 -9.9 -17.8
50 50 M T 5S+ 0 0 60 -5,-0.2 -1,-0.1 2,-0.1 123,-0.1 0.974 125.5 22.6 -63.5 -53.8 19.4 -7.1 -18.1
51 51 E T 5S+ 0 0 156 1,-0.1 -2,-0.1 122,-0.1 -1,-0.1 1.000 131.5 19.4 -76.6 -68.0 17.9 -7.8 -21.5
52 52 E T 5S+ 0 0 140 -4,-0.4 122,-0.2 121,-0.1 -3,-0.2 0.851 94.6 93.7 -76.4 -41.5 18.1 -11.5 -22.4
53 53 T < - 0 0 7 -5,-2.6 68,-0.2 -6,-0.2 -8,-0.1 -0.317 69.8-129.5 -72.5 138.6 18.7 -13.4 -19.3
54 54 K E -d 121 0A 38 66,-0.5 68,-3.2 119,-0.1 2,-0.6 -0.256 23.0-107.5 -75.5 161.5 15.7 -14.8 -17.6
55 55 L E -de 122 175A 0 119,-3.7 121,-2.5 66,-0.2 2,-2.3 -0.853 24.3-128.5 -91.0 121.9 15.0 -14.3 -13.9
56 56 V E S-d 123 0A 0 66,-3.8 68,-1.9 -2,-0.6 121,-0.2 -0.725 81.8 -44.6 -80.1 87.4 15.6 -17.5 -12.1
57 57 C E S- 0 0A 0 -2,-2.3 2,-2.9 2,-0.4 119,-0.2 -0.144 108.5 -33.5 83.0-154.4 12.2 -16.9 -10.7
58 58 N E S- 0 0A 4 1,-0.3 3,-0.1 117,-0.2 -1,-0.1 -0.578 129.5 -47.6 -77.9 71.7 10.7 -13.8 -9.3
59 59 G E S+ 0 0A 1 -2,-2.9 2,-0.6 63,-0.2 -2,-0.4 0.953 117.0 163.7 57.4 44.1 14.2 -13.5 -8.4
60 60 T E + 0 0A 4 62,-0.2 118,-1.3 116,-0.2 2,-0.4 -0.774 31.8 125.9-136.7 129.6 13.8 -16.9 -7.2
61 61 Y E +df 125 178A 0 63,-1.8 65,-1.6 -2,-0.6 2,-0.4 -0.983 34.7 178.6-134.6 123.7 15.7 -20.0 -6.3
62 62 Y E - f 0 179A 3 116,-1.9 118,-2.5 -2,-0.4 12,-0.1 -0.990 17.4-148.7-135.9 138.0 14.8 -21.4 -2.9
63 63 T - 0 0 0 -2,-0.4 118,-0.2 63,-0.3 11,-0.1 -0.413 10.1-143.3 -90.0-179.8 15.9 -24.3 -0.9
64 64 G + 0 0 0 9,-0.1 10,-0.2 -2,-0.1 -1,-0.2 0.653 22.0 178.0-104.0 -99.1 13.9 -26.2 1.5
65 65 G S S- 0 0 0 118,-0.1 2,-0.2 8,-0.1 119,-0.1 0.606 79.4 -88.6 89.6 21.4 15.4 -27.6 4.6
66 66 Q S S- 0 0 1 117,-0.2 121,-0.3 118,-0.1 3,-0.3 -0.582 93.9 -23.2 60.4-141.0 11.9 -28.6 4.9
67 67 S S S+ 0 0 1 -2,-0.2 3,-0.2 1,-0.2 283,-0.1 -0.357 124.7 60.4 -86.5 176.5 10.7 -25.5 6.6
68 68 G + 0 0 2 281,-0.3 2,-2.5 1,-0.2 280,-2.0 0.730 67.8 178.8 77.3 23.6 12.8 -23.2 8.6
69 69 V > + 0 0 0 -3,-0.3 5,-2.7 280,-0.2 59,-0.7 -0.277 24.9 151.0 -59.2 72.9 14.6 -22.8 5.3
70 70 S T 5 - 0 0 0 -2,-2.5 58,-0.3 3,-0.3 62,-0.2 0.585 68.3 -53.6 -90.5-131.3 17.0 -20.4 7.0
71 71 K T 5S+ 0 0 25 1,-0.3 10,-0.9 10,-0.2 -1,-0.1 0.391 149.6 60.3 -73.2 -22.5 20.7 -19.1 6.6
72 72 E T 5S- 0 0 6 -4,-0.2 238,-0.5 8,-0.2 -1,-0.3 0.767 126.0 -4.5 -66.3 -57.9 20.2 -22.4 6.9
73 73 a T 5S+ 0 0 0 1,-0.4 12,-0.4 -5,-0.2 11,-0.4 0.673 121.2 20.1-129.9 -64.9 18.1 -23.2 4.0
74 74 A S S+ 0 0 0 -2,-0.3 3,-1.8 -5,-0.2 2,-0.4 -0.818 77.9 9.0-169.6 161.9 23.4 -17.0 3.9
81 81 S T > S+ 0 0 0 -10,-0.9 3,-1.7 264,-0.4 -6,-0.3 -0.388 138.2 13.0 82.5-120.0 20.4 -19.4 3.7
82 82 D T 3> S+ 0 0 0 -2,-0.4 4,-1.4 1,-0.3 -1,-0.3 0.304 112.9 85.4 -73.3 -8.3 19.6 -20.4 0.1
83 83 T H <> S+ 0 0 0 -3,-1.8 4,-3.9 2,-0.2 -1,-0.3 0.681 72.3 71.6 -66.3 -20.5 22.9 -18.9 -0.2
84 84 V H <> S+ 0 0 0 -3,-1.7 4,-3.0 -11,-0.4 -1,-0.2 0.938 97.5 47.0 -56.2 -40.8 23.8 -22.3 0.7
85 85 N H 4 S+ 0 0 0 -12,-0.4 14,-0.6 2,-0.2 -2,-0.2 0.903 112.3 48.6 -65.8 -34.6 22.6 -23.1 -2.7
86 86 L H < S+ 0 0 0 -4,-1.4 13,-2.0 -11,-0.2 12,-0.7 0.979 123.9 33.0 -61.1 -50.0 24.7 -20.2 -3.9
87 87 L H < S+ 0 0 0 -4,-3.9 16,-1.4 11,-0.1 -2,-0.2 0.665 97.5 92.9 -75.2 -32.8 27.7 -21.5 -1.9
88 88 N < - 0 0 2 -4,-3.0 2,-0.2 14,-0.2 8,-0.1 -0.252 43.1-139.1-117.8-177.7 27.9 -25.3 -1.6
89 89 L + 0 0 74 5,-0.1 400,-0.2 6,-0.1 401,-0.2 -0.624 47.5 55.5-120.6 164.3 29.0 -28.9 -2.5
90 90 Y S S+ 0 0 21 399,-0.6 396,-0.4 398,-0.2 399,-0.3 0.895 83.0 48.4 68.1 117.0 28.1 -32.8 -2.9
91 91 N S S- 0 0 0 397,-0.2 393,-0.8 1,-0.2 396,-0.5 -0.586 111.2 -45.3 138.7 -64.2 25.2 -34.3 -5.0
92 92 I S S+ 0 0 0 394,-1.9 -2,-0.2 398,-0.3 -1,-0.2 -0.179 104.5 0.7-141.0-101.1 25.4 -32.6 -8.7
93 93 L S > S+ 0 0 0 394,-2.9 3,-2.9 398,-0.5 22,-0.2 0.873 95.0 83.5 -47.3 -64.0 25.9 -28.6 -10.2
94 94 E T 3> S+ 0 0 0 1,-0.4 4,-2.0 3,-0.1 5,-0.5 0.436 80.4 64.3 -37.1 -41.5 26.3 -26.0 -7.1
95 95 P T 34 S+ 0 0 21 0, 0.0 -1,-0.4 0, 0.0 -6,-0.1 0.737 107.5 53.7 -64.0 -13.3 30.1 -26.4 -6.5
96 96 C T <4 S- 0 0 1 -3,-2.9 2,-1.5 392,-0.4 3,-0.4 0.143 143.3 -58.2 -81.2-155.9 30.0 -25.0 -9.9
97 97 Y T 4 S+ 0 0 6 1,-0.3 20,-1.0 16,-0.1 3,-0.2 -0.826 71.4 149.4 -78.2 113.3 28.1 -22.0 -9.6
98 98 H S < S+ 0 0 0 -4,-2.0 19,-1.2 -2,-1.5 20,-0.4 0.744 102.3 13.3 -68.4 -44.1 25.2 -23.2 -8.4
99 99 G S S- 0 0 0 -13,-2.0 -1,-0.5 -14,-0.6 17,-0.1 -0.624 107.2 -92.8-104.9 159.5 26.0 -19.7 -7.3
100 100 T S S+ 0 0 5 -2,-0.2 13,-3.3 -3,-0.2 16,-0.2 0.771 107.9 16.6 -49.3 -39.4 28.7 -17.5 -8.8
101 101 E S S- 0 0 1 11,-0.3 2,-0.3 13,-0.0 11,-0.3 -0.994 72.8-138.0-136.9 143.9 31.3 -18.6 -6.4
102 102 P - 0 0 0 0, 0.0 9,-2.3 0, 0.0 2,-0.3 -0.726 24.4-116.8 -89.9 153.7 31.6 -21.4 -4.1
103 103 K B -H 110 0B 2 -16,-1.4 7,-0.2 -2,-0.3 2,-0.2 -0.617 33.5-138.2 -79.8 143.4 32.9 -21.1 -0.5
104 104 K > - 0 0 71 5,-2.0 3,-2.2 -2,-0.3 4,-0.1 -0.529 27.4 -94.9-101.9 175.6 36.1 -23.1 -0.0
105 105 K T 3 S+ 0 0 136 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.778 119.7 68.2 -59.6 -31.3 37.1 -25.3 2.9
106 106 N T 3 S- 0 0 60 1,-0.1 -1,-0.3 3,-0.1 -3,-0.0 0.748 99.1-137.1 -61.8 -22.7 39.0 -22.4 4.5
107 107 S S < S+ 0 0 1 -3,-2.2 -2,-0.1 2,-0.3 -1,-0.1 0.621 90.0 70.9 72.6 14.5 35.6 -20.7 5.0
108 108 H S S+ 0 0 91 1,-0.2 2,-0.1 -4,-0.1 -1,-0.1 0.691 79.4 63.9-122.0 -63.1 37.3 -17.6 3.8
109 109 L - 0 0 90 -6,-0.1 -5,-2.0 1,-0.0 2,-0.4 -0.393 59.5-157.1 -77.6 142.2 38.1 -17.7 0.2
110 110 L B -H 103 0B 12 -99,-1.9 2,-0.4 -7,-0.2 -97,-0.3 -0.932 4.8-160.8-112.9 139.8 35.5 -17.8 -2.5
111 111 H - 0 0 86 -9,-2.3 2,-0.1 -2,-0.4 -99,-0.0 -0.958 22.0-119.4-119.3 141.8 36.3 -19.1 -6.0
112 112 L - 0 0 66 -2,-0.4 -11,-0.3 -11,-0.3 -12,-0.1 -0.396 30.1-131.4 -74.2 154.2 34.1 -18.3 -9.0
113 113 N - 0 0 28 -13,-3.3 3,-0.4 1,-0.1 -17,-0.1 -0.916 12.5-155.6-120.0 138.7 32.6 -21.2 -10.6
114 114 P S S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -18,-0.1 0.750 93.3 58.4 -68.9 -30.3 32.5 -22.1 -14.2
115 115 Y S S+ 0 0 59 -22,-0.2 4,-0.1 -20,-0.1 -19,-0.1 0.631 84.8 160.3 -79.1 -19.6 29.5 -24.2 -14.3
116 116 S > - 0 0 3 -3,-0.4 3,-1.0 -16,-0.2 4,-0.4 0.437 45.1-150.2 16.5 114.2 27.6 -21.3 -12.9
117 117 W G >> S+ 0 0 0 -19,-1.2 4,-1.0 -20,-1.0 3,-0.9 0.838 99.6 61.3 -71.3 -34.5 23.8 -20.9 -13.1
118 118 S G 34 S+ 0 0 0 -20,-0.4 -72,-2.6 1,-0.3 -71,-0.3 0.424 84.1 80.5 -71.8 -0.9 24.2 -17.1 -13.2
119 119 K G <4 S+ 0 0 99 -3,-1.0 -72,-1.4 -74,-0.2 -1,-0.3 0.954 110.0 21.7 -64.4 -49.4 26.1 -17.6 -16.4
120 120 V T <4 S+ 0 0 32 -3,-0.9 -66,-0.5 -4,-0.4 2,-0.3 0.477 129.0 28.9 -88.3 -19.9 22.8 -17.9 -18.2
121 121 S E < S- d 0 54A 0 -4,-1.0 2,-0.8 -68,-0.2 -75,-0.2 -0.936 72.7-106.9-147.5 170.7 20.4 -16.2 -15.9
122 122 N E - d 0 55A 1 -68,-3.2 -66,-3.8 -2,-0.3 2,-0.5 -0.878 45.2-167.2 -95.3 108.3 19.6 -13.7 -13.2
123 123 I E -Cd 43 56A 0 -80,-1.5 -80,-2.0 -2,-0.8 2,-0.7 -0.819 10.8-160.3-105.6 130.0 19.2 -15.9 -10.2
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205 205 I S < S- 0 0 3 -3,-0.6 2,-1.7 -6,-0.2 -33,-0.1 -0.729 99.9-118.4 -87.8 130.2 4.6 -11.1 -13.4
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227 227 D H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.937 101.3 51.4 -63.2 -43.8 12.0 -45.3 -0.3
228 228 P H > S+ 0 0 18 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.870 110.4 47.3 -60.8 -34.8 11.6 -48.7 1.2
229 229 V H X S+ 0 0 39 -4,-1.1 4,-2.6 1,-0.2 5,-0.2 0.926 112.8 52.7 -65.7 -38.7 11.9 -50.4 -2.1
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231 231 L H X>S+ 0 0 2 -4,-2.9 5,-2.1 1,-0.2 4,-1.3 0.941 111.7 45.8 -62.6 -46.0 16.4 -49.2 0.7
232 232 W H ><5S+ 0 0 96 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.914 110.6 52.1 -63.7 -43.9 16.0 -52.9 -0.1
233 233 L H 3<5S+ 0 0 105 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.895 107.6 53.8 -60.7 -39.5 17.4 -52.6 -3.6
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235 235 G T X<5S+ 0 0 45 -4,-1.3 3,-0.7 -3,-0.5 -3,-0.2 0.513 78.5 127.1 104.6 5.5 20.9 -53.7 0.1
236 236 G T 3 > S- 0 0 84 1,-0.2 3,-1.3 -3,-0.1 4,-1.1 0.034 80.5-129.1 -46.7 136.0 18.9 -60.2 4.9
240 240 S H 3> S+ 0 0 86 1,-0.3 4,-3.1 2,-0.2 -1,-0.2 0.613 103.9 77.8 -64.5 -12.4 15.9 -60.9 2.8
241 241 S H 3> S+ 0 0 57 2,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.955 93.8 46.2 -62.1 -46.0 14.3 -61.8 6.1
242 242 M H <> S+ 0 0 40 -3,-1.3 4,-2.2 -5,-0.3 -2,-0.2 0.933 116.3 45.4 -62.4 -42.8 13.8 -58.2 7.0
243 243 D H X S+ 0 0 15 -4,-1.1 4,-2.8 1,-0.2 -1,-0.2 0.896 110.3 55.5 -65.5 -38.0 12.5 -57.6 3.5
244 244 G H X S+ 0 0 30 -4,-3.1 4,-2.8 1,-0.2 -2,-0.2 0.901 106.8 49.1 -62.8 -42.2 10.3 -60.7 3.8
245 245 F H X S+ 0 0 92 -4,-2.7 4,-3.1 2,-0.2 5,-0.3 0.953 109.9 52.3 -62.9 -43.7 8.7 -59.4 7.0
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262 262 I H <4 S+ 0 0 26 -3,-1.0 -1,-0.2 2,-0.2 -2,-0.1 0.906 114.3 29.4 -62.2 -42.8 4.6 -48.3 3.9
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265 265 S < + 0 0 17 -4,-1.5 -4,-0.1 -5,-0.3 7,-0.1 0.960 8.6 177.4 49.6 64.7 1.0 -48.9 8.1
266 266 I + 0 0 126 1,-0.1 2,-0.9 -16,-0.1 -1,-0.1 0.928 64.1 67.5 -63.4 -45.7 -2.2 -50.3 9.2
267 267 L > - 0 0 64 1,-0.2 5,-2.1 -18,-0.2 4,-0.3 -0.658 65.2-174.3 -85.3 110.8 -0.7 -53.2 11.1
268 268 L I >S+ 0 0 128 -2,-0.9 5,-1.0 3,-0.2 -1,-0.2 0.954 75.8 46.1 -66.5 -50.4 1.1 -51.6 14.0
269 269 S I >5S+ 0 0 67 3,-0.2 4,-1.5 2,-0.1 5,-0.2 0.982 126.8 18.0 -61.9 -72.7 2.7 -54.6 15.4
270 270 L I >5S+ 0 0 80 2,-0.2 4,-1.6 1,-0.2 5,-0.2 0.976 134.5 35.3 -66.8 -55.6 4.1 -56.4 12.5
271 271 C I >5S+ 0 0 5 -4,-0.3 4,-2.7 1,-0.2 -3,-0.2 0.944 119.2 46.3 -67.3 -48.8 4.2 -53.7 9.8
272 272 F I >>S+ 0 0 2 0, 0.0 5,-1.5 0, 0.0 4,-1.1 0.836 110.2 55.6 -58.5 -27.8 13.7 -45.6 8.9
280 280 K H X5S+ 0 0 125 -4,-1.8 4,-0.5 -5,-0.3 -2,-0.2 0.960 111.4 45.1 -65.1 -44.6 16.1 -46.1 11.6
281 281 S H <5S+ 0 0 36 -4,-2.7 6,-0.3 2,-0.2 -3,-0.2 0.981 123.1 31.0 -63.3 -59.9 18.5 -47.7 9.2
282 282 A H <5S+ 0 0 0 -4,-2.7 111,-0.5 -5,-0.2 3,-0.4 0.998 133.8 25.0 -67.2 -57.0 18.2 -45.2 6.4
283 283 L H <5S+ 0 0 18 -4,-1.1 2,-0.7 109,-0.3 110,-0.3 0.925 124.8 40.2 -76.1 -45.3 17.5 -42.0 8.3
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300 300 A T 3 S+ 0 0 57 1,-0.3 3,-0.3 14,-0.2 14,-0.2 -0.076 128.5 31.6 -49.5 141.0 31.7 -36.4 8.1
301 301 G T 3 S- 0 0 42 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 -0.035 95.6-133.2 100.5 -27.1 30.7 -35.3 11.5
302 302 Y S < S+ 0 0 136 -3,-2.2 2,-0.3 1,-0.1 -1,-0.2 0.605 72.6 65.6 55.6 22.6 29.3 -38.8 12.1
303 303 V S S- 0 0 72 -3,-0.3 11,-0.8 -4,-0.1 2,-0.1 -0.958 82.1 -94.4-159.7 173.1 26.0 -37.4 13.6
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311 311 G S S+ 0 0 0 -2,-1.3 -1,-0.1 -129,-0.2 5,-0.1 0.501 91.2 113.4 101.8 91.5 23.1 -28.1 7.2
312 312 V S > S- 0 0 0 -4,-0.4 3,-1.0 3,-0.2 -4,-0.2 -0.823 75.6 -33.3-171.7-168.3 21.4 -31.3 8.0
313 313 P T 3 S+ 0 0 10 0, 0.0 -23,-0.2 0, 0.0 -9,-0.2 -0.392 126.1 15.9 -71.6 155.7 22.9 -34.7 8.6
314 314 C T 3 S+ 0 0 9 -11,-0.8 2,-0.4 1,-0.2 -14,-0.2 0.742 102.1 117.0 61.0 27.4 26.1 -35.8 6.7
315 315 I < - 0 0 3 -3,-1.0 2,-0.8 -16,-0.1 -1,-0.2 -0.982 63.7-137.1-130.1 139.5 26.7 -32.2 5.8
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318 318 T H > S+ 0 0 41 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.887 79.1 53.2 -57.5 -48.3 31.5 -25.1 8.7
319 319 V H > S+ 0 0 17 1,-0.2 4,-1.7 -3,-0.2 -1,-0.2 0.930 117.1 36.7 -58.5 -50.2 32.8 -23.6 5.5
320 320 A H > S+ 0 0 0 -4,-0.3 4,-2.6 2,-0.2 5,-0.3 0.917 116.3 53.3 -67.3 -42.9 29.7 -21.6 4.8
321 321 T H X S+ 0 0 18 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.952 108.9 48.7 -61.3 -46.1 29.0 -20.7 8.4
322 322 K H X S+ 0 0 124 -4,-3.0 4,-0.9 -5,-0.2 -1,-0.2 0.907 113.9 47.2 -61.0 -40.8 32.5 -19.4 8.9
323 323 W H >< S+ 0 0 1 -4,-1.7 3,-1.0 -5,-0.3 6,-0.3 0.974 114.6 43.2 -63.6 -53.3 32.3 -17.3 5.8
324 324 L H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.729 107.7 59.5 -66.8 -30.8 28.8 -15.8 6.4
325 325 N H 3< S+ 0 0 46 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.755 77.1 111.8 -69.8 -27.4 29.4 -15.0 10.1
326 326 D S S+ 0 0 85 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.785 101.9 58.2 -62.9 -29.3 31.3 -9.4 10.1
328 328 A H > S+ 0 0 29 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.899 106.3 49.4 -65.3 -41.1 32.9 -8.0 7.0
329 329 V H > S+ 0 0 0 -3,-0.3 4,-2.4 -6,-0.3 -1,-0.2 0.917 110.0 50.3 -63.1 -44.3 30.7 -10.3 5.0
330 330 R H <>S+ 0 0 42 -4,-2.0 5,-3.2 1,-0.2 4,-0.3 0.874 111.1 49.5 -63.6 -38.0 27.6 -9.2 6.8
331 331 K H ><5S+ 0 0 115 -4,-1.9 3,-1.3 3,-0.2 -1,-0.2 0.931 110.5 49.1 -66.8 -41.9 28.6 -5.6 6.2
332 332 A H 3<5S+ 0 0 14 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.891 110.7 51.0 -62.5 -39.8 29.1 -6.2 2.5
333 333 V T 3<5S- 0 0 0 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.513 113.3-123.8 -72.2 -11.6 25.8 -7.9 2.4
334 334 H T < 5 + 0 0 82 -3,-1.3 -3,-0.2 -4,-0.3 2,-0.2 0.894 51.2 166.6 63.6 38.0 24.3 -4.9 4.1
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339 339 K T 3 S+ 0 0 198 1,-0.3 -1,-0.2 4,-0.0 -2,-0.1 0.293 98.2 98.7 -74.8 14.6 24.0 -7.4 16.9
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341 341 I S < S- 0 0 19 -3,-1.4 3,-0.1 -5,-0.3 -207,-0.1 -0.483 84.0-134.4 -72.1 129.4 20.7 -10.1 13.9
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351 351 L T 4 S+ 0 0 153 1,-0.2 -1,-0.2 -283,-0.1 -2,-0.0 0.891 108.3 48.7 -63.7 -45.3 9.8 -27.4 14.6
352 352 E T 4 S+ 0 0 73 2,-0.1 -1,-0.2 -206,-0.0 -2,-0.2 0.828 86.9 107.6 -66.5 -34.4 7.2 -24.7 14.5
353 353 Y < - 0 0 11 -4,-0.9 2,-0.5 -3,-0.2 -207,-0.2 -0.107 55.7-153.6 -58.6 136.3 6.2 -25.2 10.9
354 354 R B -i 146 0C 184 -209,-1.8 2,-0.8 0, 0.0 -207,-0.8 -0.941 7.0-146.5-110.8 130.8 2.9 -26.9 10.1
355 355 R + 0 0 66 -2,-0.5 -209,-0.1 1,-0.2 -2,-0.0 -0.860 23.0 170.1-106.0 108.8 2.6 -28.8 6.8
356 356 T + 0 0 92 -2,-0.8 2,-0.4 1,-0.0 -1,-0.2 0.895 53.8 77.7 -77.2 -46.2 -0.8 -28.6 5.3
357 357 N - 0 0 34 1,-0.2 3,-0.1 3,-0.0 -1,-0.0 -0.552 48.2-176.5 -85.7 124.7 -0.4 -30.0 1.9
358 358 K S S+ 0 0 103 -2,-0.4 -138,-1.5 1,-0.3 2,-0.3 0.851 73.4 9.2 -76.4 -42.7 -0.1 -33.8 1.6
359 359 T B -J 219 0D 30 -140,-0.2 3,-0.4 -139,-0.1 -1,-0.3 -0.993 54.8-141.5-146.4 149.4 0.5 -33.8 -2.2
360 360 S S > S+ 0 0 8 -142,-2.2 4,-2.4 -2,-0.3 5,-0.2 0.294 72.6 108.6 -87.5 6.6 1.3 -31.4 -5.0
361 361 K H > S+ 0 0 52 1,-0.2 4,-2.1 -143,-0.2 -1,-0.2 0.905 79.3 47.6 -57.0 -42.5 -0.9 -33.2 -7.5
362 362 N H 4 S+ 0 0 101 -3,-0.4 5,-0.3 1,-0.2 -1,-0.2 0.950 111.2 49.4 -64.7 -44.6 -3.5 -30.5 -7.5
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365 365 K H X S+ 0 0 51 -4,-2.1 4,-3.7 1,-0.3 5,-0.2 0.966 112.2 46.0 -64.2 -49.0 -2.3 -30.1 -12.8
366 366 P H > S+ 0 0 67 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.828 113.2 51.1 -59.7 -26.1 -3.6 -26.6 -12.6
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368 368 I H < S+ 0 0 24 -4,-3.2 5,-0.2 1,-0.2 -3,-0.2 0.858 103.8 66.0 -70.7 -37.8 -0.1 -27.8 -16.4
369 369 N H < S+ 0 0 133 -4,-3.7 -1,-0.2 1,-0.3 -2,-0.1 0.900 100.0 49.9 -57.2 -43.9 -3.6 -27.1 -17.6
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378 378 G S S+ 0 0 0 6,-0.4 6,-0.2 -2,-0.2 101,-0.2 -0.921 78.5 89.0-142.2 115.4 17.8 -33.4 -12.7
379 379 V S S- 0 0 0 99,-0.5 -164,-1.6 -2,-0.3 -163,-0.4 -0.302 98.6 -70.9 167.1 128.7 17.6 -33.4 -8.7
380 380 T S S+ 0 0 0 -166,-0.6 -166,-0.2 -165,-0.4 98,-0.1 0.174 110.7 22.8 -33.5 -43.0 14.6 -35.4 -7.4
381 381 D S S+ 0 0 4 -2,-0.3 2,-1.6 96,-0.1 -166,-0.3 -0.059 95.2 62.9-103.5-134.5 11.4 -33.3 -8.2
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383 383 V S S+ 0 0 0 -2,-1.6 95,-3.2 -170,-0.5 -1,-0.3 0.102 121.7 110.9-142.1 -22.1 11.4 -33.3 -13.2
384 384 F + 0 0 0 -171,-0.4 -169,-0.5 93,-0.2 -6,-0.4 -0.051 43.1 173.4 -44.8 138.6 15.0 -33.2 -11.9
385 385 D - 0 0 0 93,-0.2 95,-3.2 -6,-0.2 2,-0.3 -0.747 29.3-143.4-158.0 124.0 16.1 -36.2 -9.7
386 386 G B -l 480 0F 0 93,-0.2 3,-0.3 -2,-0.2 22,-0.3 -0.661 16.9-145.4 -74.0 135.6 19.4 -37.4 -8.2
387 387 N + 0 0 64 93,-1.7 97,-0.2 -2,-0.3 95,-0.1 -0.028 57.9 132.7 -95.6 39.4 19.4 -41.2 -8.4
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390 390 V S S- 0 0 37 -101,-0.3 6,-0.4 2,-0.3 7,-0.2 -0.867 76.6 -47.3-160.0 162.5 21.5 -45.6 -1.3
391 391 P S S+ 0 0 11 0, 0.0 2,-0.2 0, 0.0 -100,-0.1 -0.171 101.2 43.8 -64.0 131.5 20.9 -45.9 2.4
392 392 F S >S- 0 0 7 -105,-0.1 5,-2.3 -103,-0.1 2,-0.8 -0.606 92.0 -70.1 133.5 179.5 20.1 -42.8 4.5
393 393 T T 5S+ 0 0 0 -111,-0.5 -103,-0.3 4,-0.3 -104,-0.3 -0.658 102.7 57.5-111.9 85.5 17.8 -39.8 4.0
394 394 H T 5S+ 0 0 0 -105,-2.2 12,-0.9 -2,-0.8 -104,-0.5 0.064 123.5 10.8-159.0 -70.0 18.9 -37.3 1.3
395 395 G T 5S+ 0 0 0 -106,-2.7 -6,-0.4 -7,-0.3 -105,-0.2 0.874 152.6 26.8 -69.7 -51.2 19.2 -39.1 -2.1
396 396 M T 5S- 0 0 0 -107,-2.0 11,-0.5 -8,-0.4 -3,-0.3 0.995 83.8-178.3 -72.4 -61.1 17.5 -42.0 -0.4
397 397 G < - 0 0 0 -5,-2.3 -4,-0.3 -108,-0.4 10,-0.2 0.965 5.1-170.0 67.3 50.5 15.5 -40.4 2.3
398 398 L - 0 0 0 -6,-0.6 2,-0.6 6,-0.1 3,-0.2 -0.536 23.8-134.0 -69.3 149.0 14.0 -43.3 4.0
399 399 I + 0 0 10 1,-0.2 5,-0.1 -175,-0.2 -119,-0.1 -0.890 38.5 175.8-123.3 123.3 11.5 -41.7 6.3
400 400 S S S- 0 0 52 -2,-0.6 -1,-0.2 3,-0.3 -120,-0.1 0.963 84.0 -45.0 -69.5 -56.8 10.8 -42.3 9.9
401 401 D S S- 0 0 97 2,-0.2 0, 0.0 -3,-0.2 0, 0.0 0.047 119.7 -2.8-136.6-114.8 8.3 -39.4 9.9
402 402 E S S+ 0 0 94 -3,-0.1 2,-0.5 -2,-0.1 -3,-0.0 0.801 105.9 91.8 -63.0 -34.2 8.6 -36.0 8.4
403 403 L + 0 0 44 -219,-0.1 2,-0.4 -218,-0.0 -3,-0.3 -0.526 50.7 158.7 -71.1 121.2 12.1 -36.4 7.3
404 404 Y - 0 0 36 -2,-0.5 -6,-0.1 -5,-0.1 -7,-0.1 -0.930 28.9-156.0-135.4 114.8 12.0 -37.7 3.7
405 405 S - 0 0 0 -2,-0.4 2,-1.0 -220,-0.2 -10,-0.1 -0.547 38.3-108.3 -78.9 173.6 14.8 -37.3 1.4
406 406 L - 0 0 0 -12,-0.9 -20,-0.2 -191,-0.2 -26,-0.2 -0.746 31.1-154.7-108.4 103.0 13.3 -37.4 -2.0
407 407 S > - 0 0 0 -2,-1.0 4,-1.3 -11,-0.5 5,-0.1 -0.261 22.8-121.9 -66.0 152.9 14.1 -40.6 -3.8
408 408 A H > S+ 0 0 2 -22,-0.3 4,-2.2 1,-0.2 -1,-0.1 0.876 109.9 55.1 -62.5 -41.9 14.1 -40.4 -7.6
409 409 L H > S+ 0 0 48 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.881 100.1 59.2 -64.1 -38.8 11.4 -43.1 -7.9
410 410 D H > S+ 0 0 0 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.945 111.6 41.5 -54.3 -50.4 9.0 -41.3 -5.7
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